(1-methylpyrazol-3-yl)-(1-phenylcyclopentyl)methanamine

C16H21N3 — CID 103130824

IUPAC(1-methylpyrazol-3-yl)-(1-phenylcyclopentyl)methanamine
SMILESCn1ccc(C(N)C2(c3ccccc3)CCCC2)n1
InChIInChI=1S/C16H21N3/c1-19-12-9-14(18-19)15(17)16(10-5-6-11-16)13-7-3-2-4-8-13/h2-4,7-9,12,15H,5-6,10-11,17H2,1H3
InChIKeyCRSIHUHTEXKDRL-UHFFFAOYSA-N
MW255.37 g/mol
LogP2.93
Rot. Bonds3

About (1-methylpyrazol-3-yl)-(1-phenylcyclopentyl)methanamine

(1-methylpyrazol-3-yl)-(1-phenylcyclopentyl)methanamine (PubChem CID 103130824) has the molecular formula C16H21N3 and a molecular weight of 255.37 g/mol. Its IUPAC name is (1-methylpyrazol-3-yl)-(1-phenylcyclopentyl)methanamine.

Molecular Properties

Compound Name(1-methylpyrazol-3-yl)-(1-phenylcyclopentyl)methanamine
PubChem CID103130824
Molecular FormulaC16H21N3
Molecular Weight255.37 g/mol
Exact Mass255.17
IUPAC Name(1-methylpyrazol-3-yl)-(1-phenylcyclopentyl)methanamine
SMILESCn1ccc(C(N)C2(c3ccccc3)CCCC2)n1
InChIInChI=1S/C16H21N3/c1-19-12-9-14(18-19)15(17)16(10-5-6-11-16)13-7-3-2-4-8-13/h2-4,7-9,12,15H,5-6,10-11,17H2,1H3
InChIKeyCRSIHUHTEXKDRL-UHFFFAOYSA-N
XLogP2.93
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.37
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(1-methylpyrazol-3-yl)-(1-phenylcyclopentyl)methyl]hydrazine
CID 103140070
N-[(1-methylpyrazol-3-yl)-(1-phenylcyclobutyl)methyl]propan-1-amine
CID 103130823
(1-methylpyrazol-3-yl)-(1-morpholin-4-ylcyclopentyl)methanamine
CID 103131092
(1-methylpyrazol-3-yl)-phenylmethanamine
CID 65200403
(1-ethylimidazol-2-yl)-(1-phenylcyclopentyl)methanamine
CID 63968147
(1-methylimidazol-2-yl)-(1-phenylcyclopropyl)methanamine
CID 63975391
(2,4-dimethylphenyl)-(1-phenylcyclopentyl)methanamine
CID 63418067
1-(1-phenylcyclopentyl)ethanamine;hydrochloride
CID 75466877
(1R)-1-(1-phenylcyclohexyl)ethanamine
CID 78998571
N-methyl-2-(1-methylpyrazol-3-yl)-1-(1-phenylcyclobutyl)ethanamine
CID 82877218
(4-fluorophenyl)-(1-phenylcyclohexyl)methanamine
CID 63417721
(1-ethylpyrazol-4-yl)-(1-phenylcyclopentyl)methanamine
CID 63079220

Frequently Asked Questions

What is the IUPAC name of (1-methylpyrazol-3-yl)-(1-phenylcyclopentyl)methanamine?
The IUPAC name of (1-methylpyrazol-3-yl)-(1-phenylcyclopentyl)methanamine (CID 103130824) is (1-methylpyrazol-3-yl)-(1-phenylcyclopentyl)methanamine.
What is the SMILES notation for (1-methylpyrazol-3-yl)-(1-phenylcyclopentyl)methanamine?
The canonical SMILES for (1-methylpyrazol-3-yl)-(1-phenylcyclopentyl)methanamine is Cn1ccc(C(N)C2(c3ccccc3)CCCC2)n1.
What is the InChIKey of (1-methylpyrazol-3-yl)-(1-phenylcyclopentyl)methanamine?
The InChIKey is CRSIHUHTEXKDRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3/c1-19-12-9-14(18-19)15(17)16(10-5-6-11-16)13-7-3-2-4-8-13/h2-4,7-9,12,15H,5-6,10-11,17H2,1H3.
What are the key properties of (1-methylpyrazol-3-yl)-(1-phenylcyclopentyl)methanamine?
(1-methylpyrazol-3-yl)-(1-phenylcyclopentyl)methanamine has a molecular weight of 255.37 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylpyrazol-3-yl)-(1-phenylcyclopentyl)methanamine is sourced from PubChem (CID 103130824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).